BDBM50590308 CHEMBL5201689

SMILES [H][C@@]1(O[C@@H]2O[C@@H](C)[C@@H](OS([O-])(=O)=O)[C@@H](OS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)[C@H](C)O[C@@H](O[C@]2([H])[C@H](C)O[C@@H](O[C@]3([H])[C@H](C)O[C@H](OCCCCCCCC)[C@@H](OS([O-])(=O)=O)[C@@H]3OS([O-])(=O)=O)[C@@H](OS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)[C@@H](OS([O-])(=O)=O)[C@@H]1OS([O-])(=O)=O

InChI Key InChIKey=JQVIXTIWHHESDJ-UHFFFAOYSA-E

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50590308   

TargetSpike glycoprotein(2019-nCoV)
Keio University

Curated by ChEMBL
LigandPNGBDBM50590308(CHEMBL5201689)
Affinity DataKi:  3.02E+3nMAssay Description:Competitive inhibition of biotinylated heparin binding to His-tagged wild type SARS-COV-2 spike protein assessed inhibition constant incubated for 30...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
PubMed
TargetSpike glycoprotein(2019-nCoV)
Keio University

Curated by ChEMBL
LigandPNGBDBM50590308(CHEMBL5201689)
Affinity DataIC50: 8.69E+4nMAssay Description:Competitive inhibition of biotinylated heparin binding to His-tagged wild type SARS-COV-2 spike protein incubated for 300 sec by biolayer interferome...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
PubMed